1-[(5-chloranylthiophen-2-yl)methyl]-4-thiophen-2-ylsulfonyl-piperazin-1-ium

Systemtic Name: 1-[(5-chloranylthiophen-2-yl)methyl]-4-thiophen-2-ylsulfonyl-piperazin-1-ium Openeye Name: 1-[(5-chloro-2-thienyl)methyl]-4-(2-thienylsulfonyl)piperazin-1-ium CAS Name: 1-[(5-chloro-2-thiophenyl)methyl]-4-thiophen-2-ylsulfonylpiperazin-1-ium IUPAC Name: 1-[(5-chlorothiophen-2-yl)methyl]-4-thiophen-2-ylsulfonylpiperazin-1-ium Traditional Name: 1-[(5-chloro-2-thienyl)methyl]-4-(2-thienylsulfonyl)piperazin-1-ium Formula: C13H16ClN2O2S3+ MolecularWeight: 363.92634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(S2)Cl)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(S2)Cl)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C13H15ClN2O2S3/c14-12-4-3-11(20-12)10-15-5-7-16(8-6-15)21(17,18)13-2-1-9-19-13/h1-4,9H,5-8,10H2/p+1